3-(5-Chloro-2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-L-Alanine
Properties
Property | Value |
---|---|
Formula | C7H8ClN3O4++ |
IUPAC Name | (2s)-2-amino-3-(5-chloro-2,4-dioxo-pyrimidin-1-yl)propanoic acid |
Molecular Mass | 233.609 g·mol−1 |
Heat of Formation | -687.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.50 ± 1.08 D |
Volume | 238.09 Å 3 |
Surface Area | 224.28 Å 2 |
HOMO Energy | -9.82 ± 0.55 eV |
LUMO Energy | 1.92 ± eV |
Point Group Symmetry | C1 |
InChIKey | HEHLSRRDKJVHOM-BYPYZUCNSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O Cl |